Satratoxin H
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000608
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000608 contains the MS2 mass spectrum of Satratoxin H with the InChIkey MUACSCLQRGEGOE-MOCAONITSA-N.
Source: Satratoxin H
Chemical Info
| InChI | InChI=1S/C29H36O9/c1-17-7-10-27-15-34-24(32)13-19-8-11-35-28(18(2)30,25(19)33)9-5-4-6-23(31)38-20-14-22(37-21(27)12-17)29(16-36-29)26(20,27)3/h4-6,9,12-13,18,20-22,25,30,33H,7-8,10-11,14-16H2,1-3H3/b6-4+,9-5+,19-13+/t18-,20?,21+,22+,25+,26+,27+,28-,29-/m0/s1 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@@]3(CC1)COC(=O)/C=C/4\CCO[C@@]([C@@H]4O)(/C=C/C=C/C(=O)OC5[C@]3([C@]6(CO6)[C@@H](C5)O2)C)[C@H](C)O |
| InChI Key | MUACSCLQRGEGOE-MOCAONITSA-N |
| Molecular Formula | C29H36O9 |
| Exact Mass | 528.236 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 3f726548-6397-415e-8a9d-95ff33ae4b55 |
| Package id | msbnk-aafc-ac000608 |
| Resource type | HTML |
| State | active |